COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK810732
Chemical Name: (2Z)-3-[3-(4-butoxy-2-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]-2-cyano-N-cyclohexylprop-2-enamide
Smiles: CCCCOc1ccc(c(c1)C)c1nn(cc1/C=C(\C(=O)NC1CCCCC1)/C#N)c1ccccc1

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Molecular Weight: 482.63
Empirical Formula: C30H34N4O2

Physical State: Dry powder
Available Amount: 103 mg

Lipinsky:
logP: 7.086
Rotatable bonds: 8
H-donors: 1
H-acceptors: 2
PSA: 79
Number of rings: 4

     

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